5-{[acetyl(cyclopropyl)amino]methyl}-2-methoxyphenyl propane-2-sulfonate
Chemical Structure Depiction of
5-{[acetyl(cyclopropyl)amino]methyl}-2-methoxyphenyl propane-2-sulfonate
5-{[acetyl(cyclopropyl)amino]methyl}-2-methoxyphenyl propane-2-sulfonate
Compound characteristics
| Compound ID: | V029-9654 |
| Compound Name: | 5-{[acetyl(cyclopropyl)amino]methyl}-2-methoxyphenyl propane-2-sulfonate |
| Molecular Weight: | 341.42 |
| Molecular Formula: | C16 H23 N O5 S |
| Smiles: | CC(C)S(=O)(=O)Oc1cc(CN(C2CC2)C(C)=O)ccc1OC |
| Stereo: | ACHIRAL |
| logP: | 1.8105 |
| logD: | 1.8105 |
| logSw: | -2.6008 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.243 |
| InChI Key: | SAENBQQVWNQMPT-UHFFFAOYSA-N |